(4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine

C23H20F3N3 — CID 15975074

IUPAC(4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESFC(F)(F)c1ccccc1CNC1=N[C@@H](c2ccccc2)[C@@H](c2ccccc2)N1
InChIInChI=1S/C23H20F3N3/c24-23(25,26)19-14-8-7-13-18(19)15-27-22-28-20(16-9-3-1-4-10-16)21(29-22)17-11-5-2-6-12-17/h1-14,20-21H,15H2,(H2,27,28,29)/t20-,21+
InChIKeyAGGAFKRPQRBVFM-OYRHEFFESA-N
MW395.43 g/mol
LogP5.24
Rot. Bonds4

About (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine

(4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 15975074) has the molecular formula C23H20F3N3 and a molecular weight of 395.43 g/mol. Its IUPAC name is (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound Name(4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine
PubChem CID15975074
Molecular FormulaC23H20F3N3
Molecular Weight395.43 g/mol
Exact Mass395.16
IUPAC Name(4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESFC(F)(F)c1ccccc1CNC1=N[C@@H](c2ccccc2)[C@@H](c2ccccc2)N1
InChIInChI=1S/C23H20F3N3/c24-23(25,26)19-14-8-7-13-18(19)15-27-22-28-20(16-9-3-1-4-10-16)21(29-22)17-11-5-2-6-12-17/h1-14,20-21H,15H2,(H2,27,28,29)/t20-,21+
InChIKeyAGGAFKRPQRBVFM-OYRHEFFESA-N
XLogP5.24
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.43
LogP ≤ 55.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine (CID 15975074) is (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine is FC(F)(F)c1ccccc1CNC1=N[C@@H](c2ccccc2)[C@@H](c2ccccc2)N1.
What is the InChIKey of (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is AGGAFKRPQRBVFM-OYRHEFFESA-N. The full InChI is InChI=1S/C23H20F3N3/c24-23(25,26)19-14-8-7-13-18(19)15-27-22-28-20(16-9-3-1-4-10-16)21(29-22)17-11-5-2-6-12-17/h1-14,20-21H,15H2,(H2,27,28,29)/t20-,21+.
What are the key properties of (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine?
(4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 395.43 g/mol, XLogP of 5.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5R)-4,5-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 15975074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).